2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-(oxolan-2-yl)-N-pyrazin-2-yl-propanamide

Systemtic Name: 2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-(oxolan-2-yl)-N-pyrazin-2-yl-propanamide Openeye Name: 2-(3-chloro-4-methylsulfonyl-phenyl)-N-pyrazin-2-yl-3-tetrahydrofuran-2-yl-propanamide CAS Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(2-oxolanyl)-N-(2-pyrazinyl)propanamide IUPAC Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(oxolan-2-yl)-N-pyrazin-2-ylpropanamide Traditional Name: 2-(3-chloro-4-mesyl-phenyl)-N-pyrazin-2-yl-3-(tetrahydrofuryl)propionamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCO2)C(=O)NC3=NC=CN=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCO2)C(=O)NC3=NC=CN=C3)Cl

InChI

InChI=1S/C18H20ClN3O4S/c1-27(24,25)16-5-4-12(9-15(16)19)14(10-13-3-2-8-26-13)18(23)22-17-11-20-6-7-21-17/h4-7,9,11,13-14H,2-3,8,10H2,1H3,(H,21,22,23)